2773-0944 Screening compound: 2-(4-{[(1H-1,2,3-benzotriazol-1-yl)methyl]amino}-1,2,5-oxadiazol-3-yl)acetic acid

2773-0944 Screening compound: 2-(4-{[(1H-1,2,3-benzotriazol-1-yl)methyl]amino}-1,2,5-oxadiazol-3-yl)acetic acid
2773-0944 Screening compound: 2-(4-{[(1H-1,2,3-benzotriazol-1-yl)methyl]amino}-1,2,5-oxadiazol-3-yl)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2773-0944
2-(4-{[(1H-1,2,3-benzotriazol-1-yl)methyl]amino}-1,2,5-oxadiazol-3-yl)acetic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2773-0944

Molecular Formula

C11H10N6O3 (C11 H10 N6 O3)

Compound Name

2-(4-{[(1H-1,2,3-benzotriazol-1-yl)methyl]amino}-1,2,5-oxadiazol-3-yl)acetic acid

IUPAC name

2-(4-{[(1H-123-benzotriazol-1-yl)methyl]amino}-125-oxadiazol-3-yl)acetic acid

SMILES

OC(Cc1nonc1NCn1nnc2c1cccc2)=O

InChI

InChI=1S/C11H10N6O3/c18-10(19)5-8-11(15-20-14-8)12-6-17-9-4-2-1-3-7(9)13-16-17/h1-4H,5-6H2,(H,12,15)(H,18,19)

InChI Key

YNBITVYUGVJHPZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01106960

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

274.24

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.720

Distribution Coefficient, logD

-2.273

Water Solubility, LogSw

-1.59

Polar Surface Area

102.731

Acid Dissociation Constant (pKa)

4.41

Base Dissociation Constant (pKb)

1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

2773-0944 in Drug Discovery

Included in Screening Libraries

Integrin Receptors Targeted library (1715 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 2773-0944 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2773-0944?
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What is the minimum amount of 2773-0944 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2773-0944
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2773-0944
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2773-0944 available by request